| Properties | Image |
|---|
| MNX_ID | MNXM168825 |
 |
| reference | sabiorkM:21313 |
| formula | C16H24N5O10P |
| global charge | 0 |
| mol weight | 477.367 |
| InChIKey | GDPVENOGSVMRJL-FSRKKXLISA-N |
| InChI | InChI=1S/C16H24N5O10P/c1-16(2,4-22)11(25)15(26)31-32(27,28)29-3-7-9(23)10(24)14(30-7)21-6-20-8-12(17)18-5-19-13(8)21/h5-7,9-11,14,22-25H,3-4H2,1-2H3,(H,27,28)(H2,17,18,19)/t7-,9-,10-,11+,14-/m1/s1 |
| SMILES | CC(C)(CO)[C@@H](O)C(=O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=NC3=C(N)N=CN=C32)[C@H](O)[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C16H24N5O10P/c1-16(2,4-22)11(25)15(26)31-32(27,28)29-3-7-9(23)10(24)14(30-7)21-6-20-8-12(17)18-5-19-13(8)21/h5-7,9-11,14,22-25H,3-4H2,1-2H3,(H,27,28)(H2,17,18,19)/t7-,9-,10-,11+,14-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:16]([CH3:2])([CH2:4][OH:22])[C@H:11]([C:15](=[O:26])[O:31][P:32]([OH:27])(=[O:28])[O:29][CH2:3][C@@H:7]1[C@@H:9]([OH:23])[C@@H:10]([OH:24])[C@H:14]([N:21]2[CH:6]=[N:20][C:8]3=[C:12]([NH2:17])[N:18]=[CH:5][N:19]=[C:13]32)[O:30]1)[OH:25] |
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